orbital_charges     :real:2:4,2
  0.118260335296407E+001  0.908366059018407E+000  0.910554796396464E+000
  0.998475791621119E+000  0.118260335296407E+001  0.895936724794752E+000
  0.910554796396464E+000  0.101090512584477E+001
forces              :real:2:3,2
  0.412171493576527E-009  0.850410304780001E-010 -0.264942177571892E-009
 -0.601118438210139E-009  0.356755609478822E-010  0.265155221564062E-009
mermin_energy       :real:0:
 -0.347134432892078E+001
end_coords          :real:2:3,2
  0.510898028611204E+001  0.549280254488038E+001  0.338071784526020E+001
  0.510898028611204E+001  0.549280254488038E+001  0.683882057635475E+000
